SCHEMBL1064902

SCHEMBL1064902

COC(=O)c1ccc(/C=C2\COc3ccccc3C2=O)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 16/20 0.70
MAOA P21397 5/20 0.67
ACHE P22303 3/20 0.67
MIF P14174 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
TDP1 Q9NUW8 1/20 0.67
ATM Q13315 2/20 0.62
ALDH1A1 P00352 1/20 0.62
MAPT P10636 1/20 0.62
HPGD P15428 1/20 0.62
BCHE P06276 2/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8348069 1.00 MAOB (0.70) MAOBMAOAACHEMIFMEN1
SCHEMBL1064903 1.00 MAOB (0.70) MAOBMAOAACHEMIFMEN1
SCHEMBL8784896 0.86 MIF (0.65) MAOBMAOAACHEMIFMEN1
SCHEMBL13299560 0.82 MAOB (1.00) MAOBMAOAACHEMIFMEN1
SCHEMBL552334 0.81 MAOB (0.56) MAOBMAOAACHEMIFMEN1
SCHEMBL552335 0.81 MAOB (0.56) MAOBMAOAACHEMIFMEN1
SCHEMBL6993424 0.81 MIF (0.64) MAOBMAOAACHEMIFMEN1
SCHEMBL6993428 0.81 MIF (0.64) MAOBMAOAACHEMIFMEN1
SCHEMBL8548291 0.80 MAPT (0.66) MAOBMIFMEN1KMT2AATM
SCHEMBL8548289 0.80 MAPT (0.66) MAOBMIFMEN1KMT2AATM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868204-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2011-01-11 US disclosed
US-7838520-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2010-11-23 US disclosed
US-7595343-B2 Inhibitors of histone deacetylase METHYLGENE, INC. (CA) 2009-09-29 US disclosed
US-20060058298-A1 Inhibitors of histone deacetylase METHYLGENE, INC. 2006-03-16 US disclosed
US-20050288282-A1 Inhibitors of histone deacetylase METHYLGENE, INC. 2005-12-29 US disclosed
EP-1590340-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2005-11-02 EP disclosed
WO-2004069823-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2004-08-19 WO disclosed
US-20040142953-A1 Inhibitors of histone deacetylase METHYLGENE, INC. 2004-07-22 US disclosed
EP-1429765-A2 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2004-06-23 EP disclosed
US-20040106599-A1 Inhibitors of histone deacetylase 92229129 QUEBEC INC. (CA) 2004-06-03 US disclosed
WO-2003024448-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2003-03-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050288282-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 MAOB 2499/4885MAOA 1961/4885ACHE 3690/4885
US-20040106599-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 MAOB 2499/4885MAOA 1961/4885ACHE 3690/4885
US-20060058298-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 MAOB 2499/4885MAOA 1961/4885ACHE 3690/4885
US-20040142953-A1 Inhibitors of histone deacetylase HDAC1, HDAC5, HDAC3 MAOB 2499/4885MAOA 1961/4885ACHE 3690/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.